V014-0037 Screening compound: 5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide

V014-0037 Screening compound: 5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide
V014-0037 Screening compound: 5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-0037
5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V014-0037

Molecular Formula

C27H34N4O5S2 (C27 H34 N4 O5 S2)

Compound Name

5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide

IUPAC name

5-ethanesulfonamido-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzene-1-sulfonamide

SMILES

CCS(Nc(cc1)cc(S(NC(C)c2ccccc2)(=O)=O)c1N(CC1)CCN1c(cc1)ccc1OC)(=O)=O

InChI

InChI=1S/C27H34N4O5S2/c1-4-37(32,33)29-23-10-15-26(27(20-23)38(34,35)28-21(2)22-8-6-5-7-9-22)31-18-16-30(17-19-31)24-11-13-25(36-3)14-12-24/h5-15,20-21,28-29H,4,16-19H2,1-3H3/t21-/m0/s1

InChI Key

XKERFVPTNUVPTF-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19972826

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

558.72

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.725

Distribution Coefficient, logD

4.582

Water Solubility, LogSw

-4.41

Polar Surface Area

97.877

Acid Dissociation Constant (pKa)

7.81

Base Dissociation Constant (pKb)

7.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V014-0037 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V014-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-0037?
Check Price and Availability of V014-0037, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V014-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-0037
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V014-0037 available by request